3-Bromo-2-fluorobenzoic acid

• CAS: 161957-56-8
• Catalog Number: ACM161957568
• Category: Bromine Series
• Molecular Weight: 219.01
• Molecular Formula: C7H4BrFO2
• Synonyms: Benzoic acid, 3-bromo-2-fluoro-
• IUPAC Name: 3-bromo-2-fluorobenzoic acid
• Canonical SMILES: C1=CC(=C(C(=C1)Br)F)C(=O)O
• InChI: InChI=1S/C7H4BrFO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11)
• InChI Key: UVKURTLVTLRSSM-UHFFFAOYSA-N
• Boiling Point: 298.2±25.0 ºC
• Melting Point: 168 ºC
• Density: 1.789±0.06 g/ml

Custom Q&A

What is the molecular formula of 3-Bromo-2-fluorobenzoic acid?

The molecular formula of 3-Bromo-2-fluorobenzoic acid is C7H4BrFO2.

What is the molecular weight of 3-Bromo-2-fluorobenzoic acid?

The molecular weight of 3-Bromo-2-fluorobenzoic acid is 219.01 g/mol.

What is the IUPAC name of 3-Bromo-2-fluorobenzoic acid?

The IUPAC name of 3-Bromo-2-fluorobenzoic acid is 3-bromo-2-fluorobenzoic acid.

What is the InChI of 3-Bromo-2-fluorobenzoic acid?

The InChI of 3-Bromo-2-fluorobenzoic acid is InChI=1S/C7H4BrFO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11).

What is the InChIKey of 3-Bromo-2-fluorobenzoic acid?

The InChIKey of 3-Bromo-2-fluorobenzoic acid is UVKURTLVTLRSSM-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Bromo-2-fluorobenzoic acid?

The canonical SMILES of 3-Bromo-2-fluorobenzoic acid is C1=CC(=C(C(=C1)Br)F)C(=O)O.

What is the CAS number of 3-Bromo-2-fluorobenzoic acid?

The CAS number of 3-Bromo-2-fluorobenzoic acid is 161957-56-8.

What is the European Community (EC) number of 3-Bromo-2-fluorobenzoic acid?

The European Community (EC) number of 3-Bromo-2-fluorobenzoic acid is 630-302-3.

What is the DSSTox Substance ID of 3-Bromo-2-fluorobenzoic acid?

The DSSTox Substance ID of 3-Bromo-2-fluorobenzoic acid is DTXSID00371267.

Is 3-Bromo-2-fluorobenzoic acid a canonicalized compound?

Yes, 3-Bromo-2-fluorobenzoic acid is a canonicalized compound.